GitHub / ruibin-liu/moldf issues and pull requests
#40 - Not writing the @<TRIPOS>SUBSTRUCTURE section
Issue -
State: open - Opened by alfredoq about 2 months ago
#39 - Fix whitespace in `_atom_site` columns when reading PDB files
Pull Request -
State: open - Opened by kamurani 7 months ago
#38 - `moldf`-created PDB file breaks `read_pdbx` reading on title line
Issue -
State: closed - Opened by kamurani 7 months ago
- 2 comments
#37 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: open - Opened by pre-commit-ci[bot] 7 months ago
#36 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] 7 months ago
#35 - fix typo
Pull Request -
State: closed - Opened by kamurani 8 months ago
#34 - add support for decompressing files based on filename extension before opening in `read_pdb`
Pull Request -
State: closed - Opened by kamurani about 1 year ago
- 3 comments
#33 - Compressed files such as `.gz` should be supported
Issue -
State: open - Opened by kamurani about 1 year ago
- 1 comment
#32 - `read_pdb`: Trailing whitespace is not removed in column `residue_name`
Issue -
State: open - Opened by kamurani over 1 year ago
- 2 comments
#31 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] over 1 year ago
#30 - Update read_pdb.py
Pull Request -
State: closed - Opened by jihunni over 1 year ago
- 2 comments
#29 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] over 1 year ago
#28 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] over 1 year ago
#27 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] over 1 year ago
#26 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] over 1 year ago
#25 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] almost 2 years ago
#24 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] almost 2 years ago
#23 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] almost 2 years ago
#22 - Bonding
Pull Request -
State: closed - Opened by Ruibin-Liu almost 2 years ago
#21 - Renamed to MolDF/moldf
Pull Request -
State: closed - Opened by Ruibin-Liu almost 2 years ago
#17 - docs updated
Pull Request -
State: closed - Opened by Ruibin-Liu almost 2 years ago
#16 - [pre-commit.ci] pre-commit autoupdate
Pull Request -
State: closed - Opened by pre-commit-ci[bot] almost 2 years ago
#15 - added HETATM
Pull Request -
State: closed - Opened by Ruibin-Liu almost 2 years ago